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Information card for entry 4074797
Preview
| Coordinates | 4074797.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C58 H138 K2 N10 O4 Si8 Y2 |
|---|---|
| Calculated formula | C58 H138 K2 N10 O4 Si8 Y2 |
| SMILES | [C]1N(C=C2N1CCN([Y]2(N([Si](C)(C)C)[Si](C)(C)C)N([Si](C)(C)C)[Si](C)(C)C)C(C)(C)C)C(C)(C)C.[K]1[O](C)CC[O]1C |
| Title of publication | Deprotonation of N-Heterocyclic Carbenes to Afford Heterobimetallic Organolanthanide Complexes |
| Authors of publication | Arnold, Polly L.; Liddle, Stephen T. |
| Journal of publication | Organometallics |
| Year of publication | 2006 |
| Journal volume | 25 |
| Journal issue | 6 |
| Pages of publication | 1485 - 1491 |
| a | 12.8586 ± 0.0012 Å |
| b | 17.7064 ± 0.0017 Å |
| c | 19.2653 ± 0.0018 Å |
| α | 90° |
| β | 96.674 ± 0.002° |
| γ | 90° |
| Cell volume | 4356.6 ± 0.7 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.0594 |
| Residual factor for significantly intense reflections | 0.0366 |
| Weighted residual factors for significantly intense reflections | 0.0892 |
| Weighted residual factors for all reflections included in the refinement | 0.0978 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.005 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301830 (current) | 2025-08-20 | Add cross-references to PubChem compounds in COD range 4/07/ Each referenced PubChem compound corresponds to the full crystal structure. |
4074797.cif |
| 209805 | 2018-08-16 | cif/4/ Updating bibliography in entries 4060868-4060870, 4074797-4074799. Marking entries 4060868-4060870 as duplicates of entries 4074797-4074799. |
4074797.cif |
| 178636 | 2016-03-21 | cif/4/07/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/07/47. |
4074797.cif |
| 120075 | 2014-07-11 | Adding DOIs to range 4/07 structures. | 4074797.cif |
| 48830 | 2012-03-27 | ../uploads/cif-deposit/cod/cif Adding structures of 4074797, 4074798, 4074799 via cif-deposit CGI script. |
4074797.cif |
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